CID 54162404

2,2,3-trimethylbutan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H17N
SMILES
CC(C)C(C)(C)CN
InChI
InChI=1S/C7H17N/c1-6(2)7(3,4)5-8/h6H,5,8H2,1-4H3
InChIKey
XRJDGOQUIYTWGH-UHFFFAOYSA-N
Compound name
2,2,3-trimethylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

115.1361 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.143376 128.0
[M+Na]+ 138.125318 134.2
[M-H]- 114.128824 128.0
[M+NH4]+ 133.169923 150.5
[M+K]+ 154.099258 134.2
[M+H-H2O]+ 98.133360 124.0
[M+HCOO]- 160.134301 149.3
[M+CH3COO]- 174.149951 175.5
[M+Na-2H]- 136.110766 133.0
[M]+ 115.13555142 126.6
[M]- 115.13664858 126.6
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

patents stripe