CID 62773739

1-(cyclopropylamino)-3,3-dimethylbutan-2-ol

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(C)C(CNC1CC1)O
InChI
InChI=1S/C9H19NO/c1-9(2,3)8(11)6-10-7-4-5-7/h7-8,10-11H,4-6H2,1-3H3
InChIKey
WBYHBNSUFOOVLX-UHFFFAOYSA-N
Compound name
1-(cyclopropylamino)-3,3-dimethylbutan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 134.8
[M+Na]+ 180.13589 141.8
[M-H]- 156.13939 138.0
[M+NH4]+ 175.18049 150.3
[M+K]+ 196.10983 139.7
[M+H-H2O]+ 140.14393 129.6
[M+HCOO]- 202.14487 155.4
[M+CH3COO]- 216.16052 182.6
[M+Na-2H]- 178.12134 140.3
[M]+ 157.14612 136.1
[M]- 157.14722 136.1
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.