CID 3008679

6,6-dimethyl-1-nonoxy-1,3,5-triazine-2,4-diamine

Structural Information

Molecular Formula
C14H29N5O
SMILES
CCCCCCCCCON1C(=NC(=NC1(C)C)N)N
InChI
InChI=1S/C14H29N5O/c1-4-5-6-7-8-9-10-11-20-19-13(16)17-12(15)18-14(19,2)3/h4-11H2,1-3H3,(H4,15,16,17,18)
InChIKey
CPUQZOMKEFNBJV-UHFFFAOYSA-N
Compound name
6,6-dimethyl-1-nonoxy-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.2372 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.24448 170.9
[M+Na]+ 306.22642 177.2
[M-H]- 282.22992 169.2
[M+NH4]+ 301.27102 184.4
[M+K]+ 322.20036 174.0
[M+H-H2O]+ 266.23446 162.4
[M+HCOO]- 328.23540 189.5
[M+CH3COO]- 342.25105 208.7
[M+Na-2H]- 304.21187 173.5
[M]+ 283.23665 172.2
[M]- 283.23775 172.2
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

No patent data available for this compound.