CID 22096564

[1-methyl-2-({1,2,2-trimethylbicyclo[3.1.0]hexan-3-yl}methyl)cyclopropyl]methanol

Structural Information

Molecular Formula
C15H26O
SMILES
CC1(C(CC2C1(C2)C)CC3CC3(C)CO)C
InChI
InChI=1S/C15H26O/c1-13(2)10(6-12-8-15(12,13)4)5-11-7-14(11,3)9-16/h10-12,16H,5-9H2,1-4H3
InChIKey
OAKFACUIGQLOCA-UHFFFAOYSA-N
Compound name
[1-methyl-2-[(1,2,2-trimethyl-3-bicyclo[3.1.0]hexanyl)methyl]cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

586
Patents

222.19836 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.20564 157.7
[M+Na]+ 245.18758 165.9
[M-H]- 221.19108 164.5
[M+NH4]+ 240.23218 172.0
[M+K]+ 261.16152 165.7
[M+H-H2O]+ 205.19562 156.4
[M+HCOO]- 267.19656 171.5
[M+CH3COO]- 281.21221 201.8
[M+Na-2H]- 243.17303 160.0
[M]+ 222.19781 163.5
[M]- 222.19891 163.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe