CID 74623

1-hexanol, 6-(dimethylamino)-

Structural Information

Molecular Formula
C8H19NO
SMILES
CN(C)CCCCCCO
InChI
InChI=1S/C8H19NO/c1-9(2)7-5-3-4-6-8-10/h10H,3-8H2,1-2H3
InChIKey
QCXNXRUTKSIZND-UHFFFAOYSA-N
Compound name
6-(dimethylamino)hexan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

2285
Patents

145.14667 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.15395 135.9
[M+Na]+ 168.13589 141.2
[M-H]- 144.13939 135.8
[M+NH4]+ 163.18049 157.2
[M+K]+ 184.10983 141.3
[M+H-H2O]+ 128.14393 130.7
[M+HCOO]- 190.14487 159.3
[M+CH3COO]- 204.16052 180.9
[M+Na-2H]- 166.12134 140.8
[M]+ 145.14612 137.9
[M]- 145.14722 137.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe