CID 15129467

(1,2,2,3,3-pentamethylcyclopropyl)methanol

Structural Information

Molecular Formula
C9H18O
SMILES
CC1(C(C1(C)CO)(C)C)C
InChI
InChI=1S/C9H18O/c1-7(2)8(3,4)9(7,5)6-10/h10H,6H2,1-5H3
InChIKey
CCFXDKTUHPIGAN-UHFFFAOYSA-N
Compound name
(1,2,2,3,3-pentamethylcyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

142.13577 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.14305 128.2
[M+Na]+ 165.12499 139.5
[M-H]- 141.12849 133.1
[M+NH4]+ 160.16959 150.7
[M+K]+ 181.09893 139.7
[M+H-H2O]+ 125.13303 127.2
[M+HCOO]- 187.13397 149.0
[M+CH3COO]- 201.14962 179.2
[M+Na-2H]- 163.11044 136.3
[M]+ 142.13522 133.7
[M]- 142.13632 133.7
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