CID 415913

1-(ethylamino)-2-methylpropan-2-ol

Structural Information

Molecular Formula
C6H15NO
SMILES
CCNCC(C)(C)O
InChI
InChI=1S/C6H15NO/c1-4-7-5-6(2,3)8/h7-8H,4-5H2,1-3H3
InChIKey
XJUNFOQRHFYPKP-UHFFFAOYSA-N
Compound name
1-(ethylamino)-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

173
Patents

117.115364 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.122640 126.7
[M+Na]+ 140.104582 133.1
[M-H]- 116.108088 125.8
[M+NH4]+ 135.149187 148.6
[M+K]+ 156.078522 132.8
[M+H-H2O]+ 100.112624 122.8
[M+HCOO]- 162.113565 148.7
[M+CH3COO]- 176.129215 171.6
[M+Na-2H]- 138.090030 134.1
[M]+ 117.11481542 126.2
[M]- 117.11591258 126.2
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