CID 155943485

2027528-63-6

Structural Information

Molecular Formula
C13H28N2O2
SMILES
CC(C)(C)C(CCN(C)C(=O)OC(C)(C)C)N
InChI
InChI=1S/C13H28N2O2/c1-12(2,3)10(14)8-9-15(7)11(16)17-13(4,5)6/h10H,8-9,14H2,1-7H3
InChIKey
QIFZPBNRTKSNLK-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-amino-4,4-dimethylpentyl)-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.21507 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.22235 162.6
[M+Na]+ 267.20429 166.4
[M-H]- 243.20779 163.5
[M+NH4]+ 262.24889 180.4
[M+K]+ 283.17823 167.7
[M+H-H2O]+ 227.21233 157.4
[M+HCOO]- 289.21327 181.7
[M+CH3COO]- 303.22892 203.7
[M+Na-2H]- 265.18974 164.0
[M]+ 244.21452 164.7
[M]- 244.21562 164.7
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

No patent data available for this compound.