CID 203374

14241-13-5

Structural Information

Molecular Formula
C14H29NO
SMILES
CCCCC1(C(C(C1O)(C)C)N(C)C)CC
InChI
InChI=1S/C14H29NO/c1-7-9-10-14(8-2)11(15(5)6)13(3,4)12(14)16/h11-12,16H,7-10H2,1-6H3
InChIKey
VEQUOQRRYHGBHZ-UHFFFAOYSA-N
Compound name
2-butyl-3-(dimethylamino)-2-ethyl-4,4-dimethylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.22491 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.23219 159.3
[M+Na]+ 250.21413 164.7
[M-H]- 226.21763 163.1
[M+NH4]+ 245.25873 175.5
[M+K]+ 266.18807 166.6
[M+H-H2O]+ 210.22217 151.4
[M+HCOO]- 272.22311 178.7
[M+CH3COO]- 286.23876 202.5
[M+Na-2H]- 248.19958 161.0
[M]+ 227.22436 170.8
[M]- 227.22546 170.8
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

No patent data available for this compound.