CID 233757

17593-26-9

Structural Information

Molecular Formula
C12H21NO2
SMILES
CC1=CCC(CC1)C(C)(C)OC(=O)NC
InChI
InChI=1S/C12H21NO2/c1-9-5-7-10(8-6-9)12(2,3)15-11(14)13-4/h5,10H,6-8H2,1-4H3,(H,13,14)
InChIKey
SVCWPSWTLKIBPU-UHFFFAOYSA-N
Compound name
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.15723 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.16451 150.0
[M+Na]+ 234.14645 154.8
[M-H]- 210.14995 153.1
[M+NH4]+ 229.19105 168.8
[M+K]+ 250.12039 153.9
[M+H-H2O]+ 194.15449 144.4
[M+HCOO]- 256.15543 169.9
[M+CH3COO]- 270.17108 190.1
[M+Na-2H]- 232.13190 153.8
[M]+ 211.15668 148.8
[M]- 211.15778 148.8
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.