CID 9568624

101418-03-5

Structural Information

Molecular Formula
C14H27N3O2
SMILES
CC1CCC(C(C1)OC(=O)N/N=C/N(C)C)C(C)C
InChI
InChI=1S/C14H27N3O2/c1-10(2)12-7-6-11(3)8-13(12)19-14(18)16-15-9-17(4)5/h9-13H,6-8H2,1-5H3,(H,16,18)/b15-9+
InChIKey
HQSDMDPBSJPNOS-OQLLNIDSSA-N
Compound name
(5-methyl-2-propan-2-ylcyclohexyl) N-[(E)-dimethylaminomethylideneamino]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.21033 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.21761 167.5
[M+Na]+ 292.19955 169.7
[M-H]- 268.20305 172.6
[M+NH4]+ 287.24415 184.4
[M+K]+ 308.17349 170.5
[M+H-H2O]+ 252.20759 159.8
[M+HCOO]- 314.20853 189.8
[M+CH3COO]- 328.22418 213.0
[M+Na-2H]- 290.18500 166.8
[M]+ 269.20978 166.5
[M]- 269.21088 166.5
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

No patent data available for this compound.